2-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(2-methylthiazol-4-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(2-methyl-4-thiazolyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(2-methylthiazol-4-yl)acetyl]piperazino]sulfonylbenzonitrile Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=NC(=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H18N4O3S2/c1-13-19-15(12-25-13)10-17(22)20-6-8-21(9-7-20)26(23,24)16-5-3-2-4-14(16)11-18/h2-5,12H,6-10H2,1H3